6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine

C18H16F2N4 — CID 167377706

IUPAC6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine
SMILESFc1cc(F)cc(CN2CCc3cn(-c4ccccn4)nc3C2)c1
InChIInChI=1S/C18H16F2N4/c19-15-7-13(8-16(20)9-15)10-23-6-4-14-11-24(22-17(14)12-23)18-3-1-2-5-21-18/h1-3,5,7-9,11H,4,6,10,12H2
InChIKeyISHPGXUIMBILSN-UHFFFAOYSA-N
MW326.35 g/mol
LogP3.10
Rot. Bonds3

About 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine

6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine (PubChem CID 167377706) has the molecular formula C18H16F2N4 and a molecular weight of 326.35 g/mol. Its IUPAC name is 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine
PubChem CID167377706
Molecular FormulaC18H16F2N4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC Name6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine
SMILESFc1cc(F)cc(CN2CCc3cn(-c4ccccn4)nc3C2)c1
InChIInChI=1S/C18H16F2N4/c19-15-7-13(8-16(20)9-15)10-23-6-4-14-11-24(22-17(14)12-23)18-3-1-2-5-21-18/h1-3,5,7-9,11H,4,6,10,12H2
InChIKeyISHPGXUIMBILSN-UHFFFAOYSA-N
XLogP3.10
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine with MolForge

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Related Compounds

6-[(3,5-difluorophenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 20960889
5-propan-2-yl-2-pyridin-2-yl-4,6-dihydropyrrolo[3,4-c]pyrazole
CID 176692287
3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-fluoroaniline
CID 112645902
2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole
CID 96626310
2-(2-pyridin-2-yl-4,5,6,7-tetrahydroindazol-5-yl)-3,4-dihydro-1H-isoquinoline
CID 175774600
2-[(3,5-difluorophenyl)methyl]-7-methoxy-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline
CID 91109625
2-[(4-fluorophenyl)methyl]-3,4-dihydro-1H-isoquinoline
CID 3353508
6-[(4-bromophenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 20960861
7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine
CID 155400140
1-(2,3-dihydro-1H-inden-5-ylmethyl)-4-pyridin-2-ylpiperazine
CID 165351505
4-[(3,5-difluorophenyl)methyl]-2-pyridin-2-ylmorpholine
CID 127245674
2-[(3,5-difluorophenyl)methyl]-7-methoxy-3,4-dihydro-1H-isoquinolin-6-ol
CID 91227364

Frequently Asked Questions

What is the IUPAC name of 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine (CID 167377706) is 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine is Fc1cc(F)cc(CN2CCc3cn(-c4ccccn4)nc3C2)c1.
What is the InChIKey of 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine?
The InChIKey is ISHPGXUIMBILSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F2N4/c19-15-7-13(8-16(20)9-15)10-23-6-4-14-11-24(22-17(14)12-23)18-3-1-2-5-21-18/h1-3,5,7-9,11H,4,6,10,12H2.
What are the key properties of 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine?
6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine has a molecular weight of 326.35 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-difluorophenyl)methyl]-2-pyridin-2-yl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 167377706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).